[cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine

C14H20N2O2 — CID 105204466

IUPAC[cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine
SMILESNNC(c1ccc2c(c1)OCCO2)C1CCCC1
InChIInChI=1S/C14H20N2O2/c15-16-14(10-3-1-2-4-10)11-5-6-12-13(9-11)18-8-7-17-12/h5-6,9-10,14,16H,1-4,7-8,15H2
InChIKeySVTGUWDQTGHYDL-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.15
Rot. Bonds3

About [cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine

[cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine (PubChem CID 105204466) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is [cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine.

Molecular Properties

Compound Name[cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine
PubChem CID105204466
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name[cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine
SMILESNNC(c1ccc2c(c1)OCCO2)C1CCCC1
InChIInChI=1S/C14H20N2O2/c15-16-14(10-3-1-2-4-10)11-5-6-12-13(9-11)18-8-7-17-12/h5-6,9-10,14,16H,1-4,7-8,15H2
InChIKeySVTGUWDQTGHYDL-UHFFFAOYSA-N
XLogP2.15
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2,3-dihydro-1,4-benzodioxin-6-yl(oxolan-3-yl)methyl]hydrazine
CID 105229478
[2,3-dihydro-1,4-benzodioxin-6-yl-(3-ethylcyclohexyl)methyl]hydrazine
CID 105232982
[2,3-dihydro-1,4-benzodioxin-6-yl-(3,4-dimethylcyclohexyl)methyl]hydrazine
CID 105312385
N-[cycloheptyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]ethanamine
CID 62587740
cyclooctyl(2,3-dihydro-1,4-benzodioxin-6-yl)methanamine
CID 65018205
[2,3-dihydro-1,4-benzodioxin-6-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]hydrazine
CID 105301064
[2,3-dihydro-1,4-benzodioxin-6-yl-(2,2-dimethylcyclopentyl)methyl]hydrazine
CID 107193749
cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methanol
CID 61086943
[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-methylcyclopentyl)methyl]hydrazine
CID 107193810
[2,3-dihydro-1,4-benzodioxin-6-yl-(3-methyloxolan-2-yl)methyl]hydrazine
CID 105301069
N-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]ethanamine
CID 43490475
N-[cyclobutyl(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]ethanamine
CID 43489563

Frequently Asked Questions

What is the IUPAC name of [cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine?
The IUPAC name of [cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine (CID 105204466) is [cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine.
What is the SMILES notation for [cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine?
The canonical SMILES for [cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine is NNC(c1ccc2c(c1)OCCO2)C1CCCC1.
What is the InChIKey of [cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine?
The InChIKey is SVTGUWDQTGHYDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c15-16-14(10-3-1-2-4-10)11-5-6-12-13(9-11)18-8-7-17-12/h5-6,9-10,14,16H,1-4,7-8,15H2.
What are the key properties of [cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine?
[cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine has a molecular weight of 248.33 g/mol, XLogP of 2.15, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclopentyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine is sourced from PubChem (CID 105204466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).